SCHEMBL98645

SCHEMBL98645

CCCCCCCCCCCCC(C(=O)[O-])(C(CCC(C)O)(CC(C)O)C(=O)O)[N+](C)(C)C

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 8/20 0.33
CA1 P00915 2/20 0.33
FFAR1 O14842 1/20 0.33
CES2 O00748 1/20 0.31
CA2 P00918 1/20 0.31
PSMD14 O00487 2/20 0.31
PLA2G1B P04054 2/20 0.31
MMP2 P08253 2/20 0.31
ATG4B Q9Y4P1 2/20 0.31
HSP90AA1 P07900 1/20 0.31
RAD52 P43351 1/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL98889 0.92 CES2 (0.34) GPR84CA1FFAR1CES2
SCHEMBL6756058 0.92 CES2 (0.34) GPR84CA1FFAR1CES2
SCHEMBL2586062 0.77 DNM1 (0.36) GPR84CES2
SCHEMBL515391 0.77 DNM1 (0.36) GPR84CES2
SCHEMBL11089319 0.76 GPR84 (0.34) GPR84CA1FFAR1CES2CA2
SCHEMBL663117 0.76 LMNA (0.38) CES2
SCHEMBL4902282 0.73 CES2 (0.34) GPR84FFAR1CES2CA2
SCHEMBL4611396 0.72 CES2 (0.36) GPR84FFAR1CES2CA2
SCHEMBL4609450 0.72 CES2 (0.36) GPR84FFAR1CES2CA2
SCHEMBL5180083 0.70 CES2 (0.37) CES2CA2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Appears in 2073 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11638683-B2 Personal cleansing compositions THE PROCTER & GAMBLE COMPANY (US) 2023-05-02 US claimed
EP-3145481-B1 SULFATE-FREE PERSONAL CARE COMPOSITIONS RHODIA OPERATIONS (FR) 2023-04-19 EP claimed
US-20230024593-A1 PERSONAL CLEANSING COMPOSITIONS PROCTER & GAMBLE (US) 2023-01-26 US claimed
WO-2021252379-A1 NOVEL FIRE FIGHTING FOAM SYSTEMS AND METHODS FOR MAKING AND USING SAME ENVIROCOOL LP LLC (US) 2021-12-16 WO claimed
EP-3478256-A1 POTASSIUM-CONTAINING AMPHOACETATE AND BETAINE SURFACTANTS Rhodia Operations (FR) 2019-05-08 EP claimed
US-20180000711-A1 POTASSIUM-CONTAINING AMPHOACETATE AND BETAINE SURFACTANTS RHODIA OPERATIONS (FR) 2018-01-04 US claimed
WO-2018005745-A1 POTASSIUM-CONTAINING AMPHOACETATE AND BETAINE SURFACTANTS RHODIA OPERATIONS (FR) 2018-01-04 WO claimed
EP-3145481-A1 SULFATE-FREE PERSONAL CARE COMPOSITIONS Rhodia Operations (FR) 2017-03-29 EP claimed
US-20160262377-A1 POLYMER COMPOSITIONS RHODIA OPERATIONS (FR) 2016-09-15 US claimed
WO-2015179599-A1 SULFATE-FREE PERSONAL CARE COMPOSITIONS RHODIA OPERATIONS (FR) 2015-11-26 WO claimed
US-20050074417-A1 Polymeric gel system and compositions for treating keratin substrates containing same WSP CHEMICALS & TECHNOLOGY, LLC (US) 2005-04-07 US claimed
US-6608011-B2 Cleaning compounds comprising mixtures of water, stabilizer agent, buffers, preservatives, anionic, nonionic, amphoteric and cationic surfactants used as hair conditioners, soaps or gels COLGATE-PALMOLIVE COMPANY 2003-08-19 US claimed
US-20030130145-A1 Shampoos with behenyl-alcohol COLGATE-PALMOLIVE COMPANY 2003-07-10 US claimed
US-20030064044-A1 Cosmetic compositions containing water-soluble polymer complexes CHEMLOGICS GROUP, LLC 2003-04-03 US claimed
WO-2002083073-A2 COSMETIC COMPOSITIONS CONTAINING WATER-SOLUBLE POLYMER COMPLEXES WSP CHEMICAL & TECHNOLOGY LLC (US) 2002-10-24 WO claimed
US-20020107156-A1 Cleansing compositions PROCTER & GAMBLE COMPANY, THE 2002-08-08 US claimed
US-6197837-B1 Method for fluidizing tars RHODIA INC. 2001-03-06 US claimed
EP-1046390-A1 Compositions and methods for cleaning and removing contaminants from hair Calgon Corporation (US) 2000-10-25 EP claimed
US-5925604-A SHAMPOO OR BEAUTY SOAPS THAT ADD LUSTER AND SHEEN FROM EMULSIFIERS AND SURFACTANTS RHODIA INC. (US) 1999-07-20 US claimed
US-5646106-A MIXTURE OF EMULSIFIER, AMPHOTERIC SURFACTANT, NONIONIC ALCOHOL ETHOXYLATE, AND ALKYL OR ALKYL ETHER SULFATE; SHAMPOO, SOAP RHONE-POULENC SPECIALTY CHEMICALS ASIA PACIFIC PTE LTD 1997-07-08 US claimed